N6-(oxolan-2-ylmethyl)-N4-(4-phenoxyphenyl)pyrimidine-4,5,6-triamine

Systemtic Name: N6-(oxolan-2-ylmethyl)-N4-(4-phenoxyphenyl)pyrimidine-4,5,6-triamine Openeye Name: N4-(4-phenoxyphenyl)-N6-(tetrahydrofuran-2-ylmethyl)pyrimidine-4,5,6-triamine CAS Name: N6-(2-oxolanylmethyl)-N4-(4-phenoxyphenyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-(oxolan-2-ylmethyl)-4-N-(4-phenoxyphenyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(4-phenoxyanilino)pyrimidin-4-yl]-(tetrahydrofurfuryl)amine Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC2=NC=NC(=C2N)NC3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

C1CC(OC1)CNC2=NC=NC(=C2N)NC3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C21H23N5O2/c22-19-20(23-13-18-7-4-12-27-18)24-14-25-21(19)26-15-8-10-17(11-9-15)28-16-5-2-1-3-6-16/h1-3,5-6,8-11,14,18H,4,7,12-13,22H2,(H2,23,24,25,26)